Vitas-M small molecule compound
4-{[3-carbamoyl-4-(4-fluorophenyl)-5-methylthiophen-2-yl]amino}-4-oxobutanoic acid
Catalog ID
STK465079
SMILES O=C(Nc1sc(c(c1C(=O)N)c1ccc(cc1)F)C)CCC(=O)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C16H15FN2O4S MW 350.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15FN2O4S/c1-8-13(9-2-4-10(17)5-3-9)14(15(18)23)16(24-8)19-11(20)6-7-12(21)22/h2-5H,6-7H2,1H3,(H2,18,23)(H,19,20)(H,21,22)InChIKey
WBDZSSUKTYRHLN-UHFFFAOYSA-NSynonyms
3(N(3CARBAMOYL4(4FLUOROPHENYL)5METHYL2THIENYL)CARBAMOYL)PROPANOICACID
4((3carbamoyl4(4fluorophenyl)5methylthiophen2yl)amino)4oxobutanoicacid
CC1=C(C(=C(S1)NC(=O)CCC(=O)O)C(=O)N)C2=CC=C(C=C2)F
InChI=1SC16H15FN2O4Sc1813(92410(17)539)14(15(18)23)16(248)1911(20)6712(21)22h25H67H21H3(H21823)(H1920)(H2122)
MFCD06058972
ZINC000017072670
ZINC17072670
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